1-{2-methyl-4-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylethan-1-one
Chemical Structure Depiction of
1-{2-methyl-4-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylethan-1-one
1-{2-methyl-4-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylethan-1-one
Compound characteristics
| Compound ID: | V003-8897 |
| Compound Name: | 1-{2-methyl-4-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylethan-1-one |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C29 H28 N6 O |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(Cc1ccccc1)=O)c1nc2ccccc2c2nnc(c3cccc(C)c3)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.285 |
| logD: | 5.0182 |
| logSw: | -5.4895 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.14 |
| InChI Key: | FMDOGHLEVAEUMY-NRFANRHFSA-N |